SCHEMBL782951

SCHEMBL782951

Cn1c(=O)oc2ccc(-c3cccnc3)cc21

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 2/20 0.55
▸ PGR P06401 1/20 0.51
▸ TNIK Q9UKE5 1/20 0.51
▸ TSPO P30536 1/20 0.50
▸ GPR55 Q9Y2T6 1/20 0.49
▸ CYP11B2 P19099 4/20 0.47
▸ CYP11B1 P15538 3/20 0.47
▸ PIM1 P11309 1/20 0.47
▸ PIM2 Q9P1W9 1/20 0.47
▸ CYP17A1 P05093 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ BACE1 P56817 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL745069 0.90 TNIK (0.57) CYP19A1PGRTNIKGPR55CYP11B2
SCHEMBL801469 0.80 GPR55 (0.54) GPR55CYP11B2CYP11B1BACE1
SCHEMBL783391 0.78 CYP11B2 (0.45) GPR55CYP11B2CYP11B1
SCHEMBL783358 0.77 CYP11B2 (0.49) TNIKGPR55CYP11B2CYP11B1CYP1A2
SCHEMBL782507 0.77 CYP11B2 (0.48) TNIKGPR55CYP11B2
SCHEMBL768881 0.77 MAPK14 (0.58) CYP19A1CYP11B2CYP11B1CYP17A1CYP1A2
SCHEMBL782795 0.76 CYP11B2 (0.47) GPR55CYP11B2CYP11B1BACE1
SCHEMBL783487 0.76 KCNJ1 (0.51) TNIKGPR55CYP11B2CYP11B1
SCHEMBL20172639 0.76 GPR55 (0.46) GPR55
SCHEMBL782587 0.76 CYP11B2 (0.52) CYP19A1TSPOGPR55CYP11B2CYP11B1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430018-B1 BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYMTHASE INHIBITORS NOVARTIS AG (CH) 2013-07-03 — — EP disclosed
EP-2430018-B1 BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYMTHASE INHIBITORS NOVARTIS AG (CH) 2013-07-03 — — EP disclosed
US-8455522-B2 Benzoxazolone derivatives as aldosterone synthase inhibitors NOVARTIS AG (CH) 2013-06-04 — — US disclosed
US-8455522-B2 Benzoxazolone derivatives as aldosterone synthase inhibitors NOVARTIS AG (CH) 2013-06-04 — — US disclosed
US-8455522-B2 Benzoxazolone derivatives as aldosterone synthase inhibitors NOVARTIS AG (CH) 2013-06-04 — — US disclosed
US-20120071514-A1 BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS NOVARTIS AG (CH) 2012-03-22 — — US disclosed
US-20120071514-A1 BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS NOVARTIS AG (CH) 2012-03-22 — — US disclosed
US-20120071514-A1 BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS NOVARTIS AG (CH) 2012-03-22 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120071514-A1 BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS CYP11B2, CYP11B1, CYP21A2 CYP19A1 36/4885PGR 449/4885TNIK 2354/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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